1-[7-fluoranyl-3-oxidanylidene-2-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-4H-quinoxalin-6-yl]-3-pentyl-urea

Systemtic Name: 1-[7-fluoranyl-3-oxidanylidene-2-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-4H-quinoxalin-6-yl]-3-pentyl-urea Openeye Name: 1-[7-fluoro-3-oxo-2-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-4H-quinoxalin-6-yl]-3-pentyl-urea CAS Name: 1-[7-fluoro-3-oxo-2-(1-pentyl-3-pyrrolo[2,3-b]pyridinyl)-4H-quinoxalin-6-yl]-3-pentylurea IUPAC Name: 1-[7-fluoro-3-oxo-2-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-4H-quinoxalin-6-yl]-3-pentylurea Traditional Name: 1-amyl-3-[2-(1-amylpyrrolo[2,3-b]pyridin-3-yl)-7-fluoro-3-keto-4H-quinoxalin-6-yl]urea Formula: C26H31FN6O2 MolecularWeight: 478.561743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1=C(C=C2C(=C1)NC(=O)C(=N2)C3=CN(C4=C3C=CC=N4)CCCCC)F

Isomeric SMILES

CCCCCNC(=O)NC1=C(C=C2C(=C1)NC(=O)C(=N2)C3=CN(C4=C3C=CC=N4)CCCCC)F

InChI

InChI=1S/C26H31FN6O2/c1-3-5-7-11-29-26(35)32-20-15-22-21(14-19(20)27)30-23(25(34)31-22)18-16-33(13-8-6-4-2)24-17(18)10-9-12-28-24/h9-10,12,14-16H,3-8,11,13H2,1-2H3,(H,31,34)(H2,29,32,35)